Common name
N-(3-chlorophenyl)formamide
IUPAC name
N-(3-chlorophenyl)formamide
SMILES
O=CNc1cc(ccc1)Cl
Common name
N-(3-chlorophenyl)formamide
IUPAC name
N-(3-chlorophenyl)formamide
SMILES
O=CNc1cc(ccc1)Cl
INCHI
InChI=1S/C7H6ClNO/c8-6-2-1-3-7(4-6)9-5-10/h1-5H,(H,9,10)
FORMULA
C7H6ClNO
Common name
N-(3-chlorophenyl)formamide
IUPAC name
N-(3-chlorophenyl)formamide
Molecular weight
155.582
clogP
1.841
clogS
-2.393
Frequency
0.0052
HBond Acceptor
1
HBond Donor
1
Total PolarSurface Area
29.1
Number of Rings
1
Rotatable Bond
1
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD02382 | chloranocryl |
|
Herbicide | Herbicide |
| FDBD02385 | cypromid |
|
Herbicide | Herbicide |
| FDBD02387 | erlujixiancaoan |
|
Herbicide | Herbicide |
| FDBD02398 | pentanochlor |
|
Herbicide | Herbicide |
| FDBD02400 | propanil |
|
Herbicide | Herbicide |
| FDBD02487 | CEPC |
|
Herbicide | Herbicide |
| FDBD02488 | chlorbufam |
|
Herbicide | Herbicide |
| FDBD02489 | chlorpropham |
|
Herbicide | Herbicide |
| FDBD02490 | CPPC |
|
Herbicide | Herbicide |
| FDBD02496 | swep |
|
Herbicide | Herbicide |
15 ,
2
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 4i9h_ligand_1_0.mol2 | 4i9h | 1 | -6.55 | N(C=O)c1cccc(c1)Cl | 10 |
| 4x5p_ligand_1_3.mol2 | 4x5p | 1 | -6.05 | C(=O)Nc1cc(Cl)ccc1 | 10 |
| 4dhq_ligand_1_4.mol2 | 4dhq | 1 | -5.80 | c1(cc(Cl)ccc1)NC=O | 10 |
| 2viv_ligand_1_1.mol2 | 2viv | 1 | -5.74 | c1cc(Cl)cc(c1)NC=O | 10 |
| 2viw_ligand_1_2.mol2 | 2viw | 1 | -5.72 | c1cc(Cl)cc(c1)NC=O | 10 |
| 4dhs_ligand_1_4.mol2 | 4dhs | 0.944444 | -5.97 | c1(cc(Cl)cc(Cl)c1)NC=O | 11 |
| 4dhu_ligand_1_4.mol2 | 4dhu | 0.918919 | -5.97 | c1(c(Cl)c(Cl)ccc1)NC=O | 11 |
| 2ywp_ligand_1_1.mol2 | 2ywp | 0.85 | -6.87 | c1(cc(ccc1)Cl)NC(=O)N | 11 |
| 4i9u_ligand_2_0.mol2 | 4i9u | 0.85 | -6.85 | CC(=O)Nc1cc(ccc1)Cl | 11 |
| 4i9h_ligand_2_11.mol2 | 4i9h | 0.85 | -6.81 | c1(cccc(c1)Cl)NC(=O)C | 11 |
282 ,
29
